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An Early Molecular Dynamics Attempt at Calculating Solvation Number

An Early Molecular Dynamics Attempt at Calculating Solvation Number [Pg.154]

These sophisticated calculations are impressive but they err in representing their results as solvation numbers. They are, rather, coordination numbers and grow larger with an increase in the size of the ion (in contrast to the behavior of the hydration numbers, which deaease as the ion size increases). [Pg.154]




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Dynamic calculations

Dynamical calculations

Molecular calculated

Molecular calculations

Molecular dynamics calculations

Molecular number

Solvated solvation numbers

Solvation calculations

Solvation number

Solvation, molecular dynamics

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